Geometry & MOs

Info

ID:	129983
PubChem CID:	51074470
Reduced:	N3O3H19C20 (1)
Stoich.:	A3B3C19D20 (1)
Weight, g/mol:	335.152144
ΔH_f, kcal/mol:	-40.73
Dipole, Da:	3.61
IP(EA), eV:	-8.4(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-benzofuran-2-yl(phenyl)methyl]oxane-4-carboxamide

Drug info:

PubChemData

Smile

COCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C3CCC4=C3C2=CC=C4

DOS

IR

Vibrations